2-bromo-3-methoxy-6-methylpyridine;ethane

C11H20BrNO — CID 144796120

IUPAC2-bromo-3-methoxy-6-methylpyridine;ethane
SMILESCC.CC.COc1ccc(C)nc1Br
InChIInChI=1S/C7H8BrNO.2C2H6/c1-5-3-4-6(10-2)7(8)9-5;2*1-2/h3-4H,1-2H3;2*1-2H3
InChIKeyATMFFZCCTLPQPJ-UHFFFAOYSA-N
MW262.19 g/mol
LogP4.21
Rot. Bonds1

About 2-bromo-3-methoxy-6-methylpyridine;ethane

2-bromo-3-methoxy-6-methylpyridine;ethane (PubChem CID 144796120) has the molecular formula C11H20BrNO and a molecular weight of 262.19 g/mol. Its IUPAC name is 2-bromo-3-methoxy-6-methylpyridine;ethane.

Molecular Properties

Compound Name2-bromo-3-methoxy-6-methylpyridine;ethane
PubChem CID144796120
Molecular FormulaC11H20BrNO
Molecular Weight262.19 g/mol
Exact Mass261.07
IUPAC Name2-bromo-3-methoxy-6-methylpyridine;ethane
SMILESCC.CC.COc1ccc(C)nc1Br
InChIInChI=1S/C7H8BrNO.2C2H6/c1-5-3-4-6(10-2)7(8)9-5;2*1-2/h3-4H,1-2H3;2*1-2H3
InChIKeyATMFFZCCTLPQPJ-UHFFFAOYSA-N
XLogP4.21
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.19
LogP ≤ 54.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

2-bromo-6-methyl-3-propan-2-yloxypyridine
CID 154814935
ethane;3-methoxy-N,N,6-trimethylpyridin-2-amine
CID 162737394
azane;3-bromo-2-methoxy-6-methylpyridine
CID 175713094
2-bromo-3-methoxy-6-methylsulfonylpyridine
CID 162523318
2-bromo-3-methoxy-6-phenylpyridine
CID 10869126
3-methoxy-6-methyl-2-(trifluoromethoxy)pyridine
CID 130093146
2-[(2-bromo-6-methyl-3-pyridinyl)oxy]-5-chloropyrimidine
CID 133476901
bis(3-methoxy-6-methyl-2-pyridinyl)methanol
CID 101366814
2-[(2-bromo-6-methyl-3-pyridinyl)oxy]-3,3-dimethylbutanoic acid
CID 87234975
2-cyclopropyl-3-methoxy-6-methylpyridine
CID 126627293
3-methoxy-6-methyl-2-prop-1-ynylpyridine
CID 69178147
2-(3-methoxy-6-methyl-2-pyridinyl)propan-2-amine
CID 84768211

Frequently Asked Questions

What is the IUPAC name of 2-bromo-3-methoxy-6-methylpyridine;ethane?
The IUPAC name of 2-bromo-3-methoxy-6-methylpyridine;ethane (CID 144796120) is 2-bromo-3-methoxy-6-methylpyridine;ethane.
What is the SMILES notation for 2-bromo-3-methoxy-6-methylpyridine;ethane?
The canonical SMILES for 2-bromo-3-methoxy-6-methylpyridine;ethane is CC.CC.COc1ccc(C)nc1Br.
What is the InChIKey of 2-bromo-3-methoxy-6-methylpyridine;ethane?
The InChIKey is ATMFFZCCTLPQPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8BrNO.2C2H6/c1-5-3-4-6(10-2)7(8)9-5;2*1-2/h3-4H,1-2H3;2*1-2H3.
What are the key properties of 2-bromo-3-methoxy-6-methylpyridine;ethane?
2-bromo-3-methoxy-6-methylpyridine;ethane has a molecular weight of 262.19 g/mol, XLogP of 4.21, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-3-methoxy-6-methylpyridine;ethane is sourced from PubChem (CID 144796120), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).